Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2237290
Preview
Coordinates | 2237290.cif |
---|---|
Structure factors | 2237290.hkl |
Original IUCr paper | HTML |
Chemical name | Dichloridodi-μ~2~-hydroxido-di-μ~3~-oxido-octaphenyltetratin(IV) dimethyl sulfoxide disolvate |
---|---|
Formula | C52 H54 Cl2 O6 S2 Sn4 |
Calculated formula | C52 H54 Cl2 O6 S2 Sn4 |
SMILES | c1(ccccc1)[Sn]1([O]2[Sn]3([O]([Sn](c4ccccc4)(c4ccccc4)([OH]3)Cl)[Sn]2([OH]1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)c1ccccc1.O=S(C)C.O=S(C)C |
Title of publication | Dichloridodi-μ~2~-hydroxido-di-μ~3~-oxido-octaphenyltetratin(IV) dimethyl sulfoxide disolvate |
Authors of publication | Foladi, Shahrbano; Khazaei, Parivash; Attar Gharamaleki, Jafar; Notash, Behrouz; Rofouei, Mohammad Kazem |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 2 |
Pages of publication | m91 |
a | 11.521 ± 0.002 Å |
b | 19.372 ± 0.004 Å |
c | 11.854 ± 0.002 Å |
α | 90° |
β | 93.61 ± 0.03° |
γ | 90° |
Cell volume | 2640.4 ± 0.8 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0397 |
Residual factor for significantly intense reflections | 0.0304 |
Weighted residual factors for significantly intense reflections | 0.0757 |
Weighted residual factors for all reflections included in the refinement | 0.0789 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2237290.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.